N3-[bis(azanyl)methylidene]-5-(2-chloranyl-5-methyl-phenyl)-N1-(2-dimethylaminoethyl)benzene-1,3-dicarboxamide

Systemtic Name: N3-[bis(azanyl)methylidene]-5-(2-chloranyl-5-methyl-phenyl)-N1-(2-dimethylaminoethyl)benzene-1,3-dicarboxamide Openeye Name: 5-(2-chloro-5-methyl-phenyl)-N3-(diaminomethylene)-N1-(2-dimethylaminoethyl)benzene-1,3-dicarboxamide CAS Name: 5-(2-chloro-5-methylphenyl)-N3-(diaminomethylidene)-N1-(2-dimethylaminoethyl)benzene-1,3-dicarboxamide IUPAC Name: 5-(2-chloro-5-methylphenyl)-3-N-(diaminomethylidene)-1-N-(2-dimethylaminoethyl)benzene-1,3-dicarboxamide Traditional Name: 5-(2-chloro-5-methyl-phenyl)-N'-(diaminomethylene)-N-(2-dimethylaminoethyl)isophthalamide Formula: C20H24ClN5O2 MolecularWeight: 401.88986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)C2=CC(=CC(=C2)C(=O)NCCN(C)C)C(=O)N=C(N)N

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)C2=CC(=CC(=C2)C(=O)NCCN(C)C)C(=O)N=C(N)N

InChI

InChI=1S/C20H24ClN5O2/c1-12-4-5-17(21)16(8-12)13-9-14(18(27)24-6-7-26(2)3)11-15(10-13)19(28)25-20(22)23/h4-5,8-11H,6-7H2,1-3H3,(H,24,27)(H4,22,23,25,28)